SCHEMBL25429366

SCHEMBL25429366

CCN(CC)c1ccc2cc(-c3cc(=O)[nH]c(NC(=O)NCCCCC(NC(=O)C(NC(=O)C(C)N(C(=O)OC(C)(C)C)c4ccccc4)C(C)C)C(=O)NC(C)C(=O)NC(CC(C)C)C(=O)OC)n3)c(=O)oc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDYL2 Q8N8U2 4/20 0.34
▸ CBX7 O95931 3/20 0.34
▸ CBX8 Q9HC52 3/20 0.34
▸ CBX4 O00257 2/20 0.34
▸ CTSB P07858 5/20 0.32
▸ CTSK P43235 5/20 0.32
▸ MAPT P10636 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ USP2 O75604 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ ATM Q13315 2/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25430751 0.88 MAP1LC3B (0.36) CDYL2CBX7CBX8CBX4MAPT
SCHEMBL25430909 0.88 CYP19A1 (0.36) CDYL2CBX7CBX8CBX4MAPT
SCHEMBL25429462 0.86 MAP1LC3B (0.37) MAPTMEN1NPC1USP2LMNA
SCHEMBL25334968 0.83 CYP19A1 (0.38) MAPTMEN1NPC1USP2LMNA
SCHEMBL25336517 0.80 CYP19A1 (0.39) MAPTMEN1NPC1USP2LMNA
SCHEMBL25431445 0.77 MAPT (0.40) MAPTMEN1NPC1USP2LMNA
SCHEMBL25431450 0.77 MAPT (0.40) MAPTMEN1NPC1USP2LMNA
SCHEMBL25333502 0.71 CYP19A1 (0.46) MAPTMEN1NPC1USP2LMNA
SCHEMBL25333492 0.71 CYP19A1 (0.46) MAPTMEN1NPC1USP2LMNA
SCHEMBL7275108 0.60 MME (0.47) MAPTMEN1KMT2AALDH1A1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023148785-A1 FLUORESCENT AND SELF-ASSEMBLING UREIDOPYRIMIDINONE CONJUGATES AND PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-08-10 — — WO claimed
WO-2023148785-A1 FLUORESCENT AND SELF-ASSEMBLING UREIDOPYRIMIDINONE CONJUGATES AND PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-08-10 — — WO disclosed
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